N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-yl-amino]ethanamide

Systemtic Name: N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-yl-amino]ethanamide Openeye Name: N-isobutyl-2-[isopropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-(2-methylpropyl)-N-[(1-methyl-2-pyrrolyl)methyl]-2-[[[4-(methylthio)anilino]-oxomethyl]-propan-2-ylamino]acetamide IUPAC Name: N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-ylamino]acetamide Traditional Name: N-isobutyl-2-[isopropyl-[[4-(methylthio)phenyl]carbamoyl]amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C23H34N4O2S MolecularWeight: 430.60666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CN1C)C(=O)CN(C(C)C)C(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)CN(CC1=CC=CN1C)C(=O)CN(C(C)C)C(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C23H34N4O2S/c1-17(2)14-26(15-20-8-7-13-25(20)5)22(28)16-27(18(3)4)23(29)24-19-9-11-21(30-6)12-10-19/h7-13,17-18H,14-16H2,1-6H3,(H,24,29)